4-[[1-(5-methylthiophene-2-carbonyl)piperidin-4-yl]methoxy]pyridine-2-carboxamide

C18H21N3O3S — CID 166600547

IUPAC4-[[1-(5-methylthiophene-2-carbonyl)piperidin-4-yl]methoxy]pyridine-2-carboxamide
SMILESCc1ccc(C(=O)N2CCC(COc3ccnc(C(N)=O)c3)CC2)s1
InChIInChI=1S/C18H21N3O3S/c1-12-2-3-16(25-12)18(23)21-8-5-13(6-9-21)11-24-14-4-7-20-15(10-14)17(19)22/h2-4,7,10,13H,5-6,8-9,11H2,1H3,(H2,19,22)
InChIKeyZZIAOXXUGDPZRA-UHFFFAOYSA-N
MW359.45 g/mol
LogP2.48
Rot. Bonds5

About 4-[[1-(5-methylthiophene-2-carbonyl)piperidin-4-yl]methoxy]pyridine-2-carboxamide

4-[[1-(5-methylthiophene-2-carbonyl)piperidin-4-yl]methoxy]pyridine-2-carboxamide (PubChem CID 166600547) has the molecular formula C18H21N3O3S and a molecular weight of 359.45 g/mol. Its IUPAC name is 4-[[1-(5-methylthiophene-2-carbonyl)piperidin-4-yl]methoxy]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-[[1-(5-methylthiophene-2-carbonyl)piperidin-4-yl]methoxy]pyridine-2-carboxamide
PubChem CID166600547
Molecular FormulaC18H21N3O3S
Molecular Weight359.45 g/mol
Exact Mass359.13
IUPAC Name4-[[1-(5-methylthiophene-2-carbonyl)piperidin-4-yl]methoxy]pyridine-2-carboxamide
SMILESCc1ccc(C(=O)N2CCC(COc3ccnc(C(N)=O)c3)CC2)s1
InChIInChI=1S/C18H21N3O3S/c1-12-2-3-16(25-12)18(23)21-8-5-13(6-9-21)11-24-14-4-7-20-15(10-14)17(19)22/h2-4,7,10,13H,5-6,8-9,11H2,1H3,(H2,19,22)
InChIKeyZZIAOXXUGDPZRA-UHFFFAOYSA-N
XLogP2.48
TPSA85.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.45
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[4-(5-methylthiophene-2-carbonyl)piperazin-1-yl]pyridine-2-carboxamide
CID 133313979
4-[[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]methoxy]pyridine-2-carboxamide
CID 166602502
4-[[1-(4-methylphthalazin-1-yl)piperidin-4-yl]methoxy]pyridine-2-carboxamide
CID 166603752
(5-methylthiophen-2-yl)-[4-(2-phenoxyethyl)piperidin-1-yl]methanone
CID 53150687
4-[[1-(5-bromo-2-pyridinyl)piperidin-4-yl]methoxy]pyridine-2-carboxamide
CID 166601537
4-[[1-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperidin-4-yl]methoxy]pyridine-2-carboxamide
CID 166603626
[4-[[1-(5-methylthiophene-2-carbonyl)piperidin-3-yl]methoxy]phenyl]-piperidin-1-ylmethanone
CID 53150030
4-[[1-[(3-chlorophenyl)methyl]piperidin-4-yl]methoxy]pyridine-2-carboxamide
CID 166603390
4-[[1-[(3-bromophenyl)methyl]piperidin-4-yl]methoxy]pyridine-2-carboxamide
CID 166603548
4-[[1-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-ylmethyl)piperidin-4-yl]methoxy]pyridine-2-carboxamide
CID 166602593
4-[(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-4-yl)methoxy]pyridine-2-carboxamide
CID 166603591
4-[[1-(6-cyclobutylpyrimidin-4-yl)piperidin-4-yl]methoxy]pyridine-2-carboxamide
CID 166602822

Frequently Asked Questions

What is the IUPAC name of 4-[[1-(5-methylthiophene-2-carbonyl)piperidin-4-yl]methoxy]pyridine-2-carboxamide?
The IUPAC name of 4-[[1-(5-methylthiophene-2-carbonyl)piperidin-4-yl]methoxy]pyridine-2-carboxamide (CID 166600547) is 4-[[1-(5-methylthiophene-2-carbonyl)piperidin-4-yl]methoxy]pyridine-2-carboxamide.
What is the SMILES notation for 4-[[1-(5-methylthiophene-2-carbonyl)piperidin-4-yl]methoxy]pyridine-2-carboxamide?
The canonical SMILES for 4-[[1-(5-methylthiophene-2-carbonyl)piperidin-4-yl]methoxy]pyridine-2-carboxamide is Cc1ccc(C(=O)N2CCC(COc3ccnc(C(N)=O)c3)CC2)s1.
What is the InChIKey of 4-[[1-(5-methylthiophene-2-carbonyl)piperidin-4-yl]methoxy]pyridine-2-carboxamide?
The InChIKey is ZZIAOXXUGDPZRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O3S/c1-12-2-3-16(25-12)18(23)21-8-5-13(6-9-21)11-24-14-4-7-20-15(10-14)17(19)22/h2-4,7,10,13H,5-6,8-9,11H2,1H3,(H2,19,22).
What are the key properties of 4-[[1-(5-methylthiophene-2-carbonyl)piperidin-4-yl]methoxy]pyridine-2-carboxamide?
4-[[1-(5-methylthiophene-2-carbonyl)piperidin-4-yl]methoxy]pyridine-2-carboxamide has a molecular weight of 359.45 g/mol, XLogP of 2.48, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[1-(5-methylthiophene-2-carbonyl)piperidin-4-yl]methoxy]pyridine-2-carboxamide is sourced from PubChem (CID 166600547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).